N-[3-chloro-4-(difluoromethoxy)phenyl]-2-({1-cyclopropyl-4-[(1,3-dimethyl-1H-pyrazol-4-yl)methylidene]-5-oxo-4,5-dihydro-1H-imidazol-2-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-[3-chloro-4-(difluoromethoxy)phenyl]-2-({1-cyclopropyl-4-[(1,3-dimethyl-1H-pyrazol-4-yl)methylidene]-5-oxo-4,5-dihydro-1H-imidazol-2-yl}sulfanyl)acetamide
N-[3-chloro-4-(difluoromethoxy)phenyl]-2-({1-cyclopropyl-4-[(1,3-dimethyl-1H-pyrazol-4-yl)methylidene]-5-oxo-4,5-dihydro-1H-imidazol-2-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | Y502-4290 |
| Compound Name: | N-[3-chloro-4-(difluoromethoxy)phenyl]-2-({1-cyclopropyl-4-[(1,3-dimethyl-1H-pyrazol-4-yl)methylidene]-5-oxo-4,5-dihydro-1H-imidazol-2-yl}sulfanyl)acetamide |
| Molecular Weight: | 495.93 |
| Molecular Formula: | C21 H20 Cl F2 N5 O3 S |
| Smiles: | Cc1c(/C=C2/C(N(C3CC3)C(=N2)SCC(Nc2ccc(c(c2)[Cl])OC(F)F)=O)=O)cn(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.0751 |
| logD: | 3.0749 |
| logSw: | -3.4692 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.517 |
| InChI Key: | AFFXENUIOOHTOY-UHFFFAOYSA-N |